Vitas-M small molecule compound
(5E)-5-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-1-(3,5-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170674
SMILES CCOc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2cc(C)cc(c2)C)cc(c1O)Br
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H19BrN2O5 MW 459.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O5/c1-4-29-17-10-13(9-16(22)18(17)25)8-15-19(26)23-21(28)24(20(15)27)14-6-11(2)5-12(3)7-14/h5-10,25H,4H2,1-3H3,(H,23,26,28)/b15-8+InChIKey
PDKZBJZVHPECSC-OVCLIPMQSA-NSynonyms
(5E)5((3BROMO5ETHOXY4HYDROXYPHENYL)METHYLIDENE)1(35DIMETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5(3BROMO5ETHOXY4HYDROXYBENZYLIDENE)1(35DIMETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
1(35DIMETHYLPHENYL)5((3BROMO5ETHOXY4HYDROXYPHENYL)METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC(=C3)C)C)Br)O
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cc(C)cc(c2)C)cc(c1O)Br
InChI=1SC21H19BrN2O5c1429171013(916(22)18(17)25)81519(26)2321(28)24(20(15)27)14611(2)512(3)714h51025H4H213H3(H232628)b158+
MFCD01610285
ZINC000009259866
ZINC09259866
ZINC9259866
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